ethyl (E)-3-[4-(3-oxidanyl-1-pyridin-3-yl-propyl)phenyl]but-2-enoate

Systemtic Name: ethyl (E)-3-[4-(3-oxidanyl-1-pyridin-3-yl-propyl)phenyl]but-2-enoate Openeye Name: ethyl (E)-3-[4-[3-hydroxy-1-(3-pyridyl)propyl]phenyl]but-2-enoate CAS Name: (E)-3-[4-[3-hydroxy-1-(3-pyridinyl)propyl]phenyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(3-hydroxy-1-pyridin-3-ylpropyl)phenyl]but-2-enoate Traditional Name: (E)-3-[4-[3-hydroxy-1-(3-pyridyl)propyl]phenyl]but-2-enoic acid ethyl ester Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)C1=CC=C(C=C1)C(CCO)C2=CN=CC=C2

Isomeric SMILES

CCOC(=O)/C=C(\C)/C1=CC=C(C=C1)C(CCO)C2=CN=CC=C2

InChI

InChI=1S/C20H23NO3/c1-3-24-20(23)13-15(2)16-6-8-17(9-7-16)19(10-12-22)18-5-4-11-21-14-18/h4-9,11,13-14,19,22H,3,10,12H2,1-2H3/b15-13+